2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-5-nitro-benzenecarbonitrile

Systemtic Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-5-nitro-benzenecarbonitrile Openeye Name: 2-indan-5-ylsulfanyl-5-nitro-benzonitrile CAS Name: 2-(2,3-dihydro-1H-inden-5-ylthio)-5-nitrobenzonitrile IUPAC Name: 2-(2,3-dihydro-1H-inden-5-ylsulfanyl)-5-nitrobenzonitrile Traditional Name: 2-(indan-5-ylthio)-5-nitro-benzonitrile Formula: C16H12N2O2S MolecularWeight: 296.34368

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)SC3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)SC3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H12N2O2S/c17-10-13-8-14(18(19)20)5-7-16(13)21-15-6-4-11-2-1-3-12(11)9-15/h4-9H,1-3H2